2-(2,5-dimethylphenoxy)-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]ethanamide

Systemtic Name: 2-(2,5-dimethylphenoxy)-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]ethanamide Openeye Name: 2-(2,5-dimethylphenoxy)-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]acetamide CAS Name: 2-(2,5-dimethylphenoxy)-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]acetamide IUPAC Name: 2-(2,5-dimethylphenoxy)-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]acetamide Traditional Name: 2-(2,5-dimethylphenoxy)-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]acetamide Formula: C20H26N3O3+ MolecularWeight: 356.43874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC(=O)NCC2=C[NH+]=C(C=C2)N3CCOCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCC(=O)NCC2=C[NH+]=C(C=C2)N3CCOCC3

InChI

InChI=1S/C20H25N3O3/c1-15-3-4-16(2)18(11-15)26-14-20(24)22-13-17-5-6-19(21-12-17)23-7-9-25-10-8-23/h3-6,11-12H,7-10,13-14H2,1-2H3,(H,22,24)/p+1